USER MOD reduce.3.24.130724 H: found=0, std=0, add=176, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 176 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 G O2' : rot 180:sc= -0.419 USER MOD Single : A 1 G O5' : rot 180:sc= 0 USER MOD Single : A 2 A O2' : rot -7:sc= -0.208 USER MOD Single : A 3 G O2' : rot -7:sc= 0.11 USER MOD Single : A 4 G O2' : rot -15:sc= -0.266 USER MOD Single : A 5 U O2' : rot -18:sc= -0.214 USER MOD Single : A 6 C O2' : rot 180:sc= -0.343 USER MOD Single : A 7 U O2' : rot 180:sc= -0.439 USER MOD Single : A 8 C O2' : rot -37:sc= 0.116 USER MOD Single : A 8 C O3' : rot 180:sc= 0.127 USER MOD Single : B 9 G O2' : rot 180:sc= -0.377 USER MOD Single : B 9 G O5' : rot 18:sc= 0.253 USER MOD Single : B 10 A O2' : rot 180:sc= -0.217 USER MOD Single : B 11 G O2' : rot 180:sc= -0.371 USER MOD Single : B 12 G O2' : rot -28:sc= -0.0142 USER MOD Single : B 13 U O2' : rot 180:sc= -0.569 USER MOD Single : B 14 C O2' : rot -28:sc= 0.155 USER MOD Single : B 15 U O2' : rot -28:sc= 0.179 USER MOD Single : B 16 C O2' : rot -18:sc= 0.125 USER MOD Single : B 16 C O3' : rot 180:sc= 0.137 USER MOD ----------------------------------------------------------------- ATOM 1 O5' G A 1 6.253 -10.350 3.978 1.00 0.00 O ATOM 2 C5' G A 1 6.064 -9.243 4.831 1.00 0.00 C ATOM 3 C4' G A 1 6.980 -8.099 4.396 1.00 0.00 C ATOM 4 O4' G A 1 6.619 -7.610 3.106 1.00 0.00 O ATOM 5 C3' G A 1 6.863 -6.903 5.319 1.00 0.00 C ATOM 6 O3' G A 1 7.602 -7.069 6.514 1.00 0.00 O ATOM 7 C2' G A 1 7.445 -5.827 4.439 1.00 0.00 C ATOM 8 O2' G A 1 8.853 -5.941 4.399 1.00 0.00 O ATOM 9 C1' G A 1 6.886 -6.200 3.074 1.00 0.00 C ATOM 10 N9 G A 1 5.631 -5.460 2.846 1.00 0.00 N ATOM 11 C8 G A 1 4.342 -5.859 3.076 1.00 0.00 C ATOM 12 N7 G A 1 3.446 -4.963 2.768 1.00 0.00 N ATOM 13 C5 G A 1 4.197 -3.885 2.309 1.00 0.00 C ATOM 14 C6 G A 1 3.776 -2.605 1.843 1.00 0.00 C ATOM 15 O6 G A 1 2.631 -2.176 1.720 1.00 0.00 O ATOM 16 N1 G A 1 4.860 -1.801 1.510 1.00 0.00 N ATOM 17 C2 G A 1 6.182 -2.177 1.601 1.00 0.00 C ATOM 18 N2 G A 1 7.093 -1.265 1.246 1.00 0.00 N ATOM 19 N3 G A 1 6.581 -3.379 2.025 1.00 0.00 N ATOM 20 C4 G A 1 5.538 -4.178 2.364 1.00 0.00 C ATOM 0 H5' G A 1 6.280 -9.524 5.862 1.00 0.00 H new ATOM 0 H5'' G A 1 5.023 -8.921 4.800 1.00 0.00 H new ATOM 0 H4' G A 1 7.987 -8.515 4.408 1.00 0.00 H new ATOM 0 H3' G A 1 5.852 -6.706 5.676 1.00 0.00 H new ATOM 0 H2' G A 1 7.209 -4.816 4.771 1.00 0.00 H new ATOM 0 HO2' G A 1 9.222 -5.239 3.824 1.00 0.00 H new ATOM 0 HO5' G A 1 5.666 -11.083 4.259 1.00 0.00 H new ATOM 0 H1' G A 1 7.586 -5.954 2.275 1.00 0.00 H new ATOM 0 H8 G A 1 4.089 -6.830 3.477 1.00 0.00 H new ATOM 0 H1 G A 1 4.661 -0.859 1.172 1.00 0.00 H new ATOM 0 H21 G A 1 8.086 -1.491 1.294 1.00 0.00 H new ATOM 0 H22 G A 1 6.794 -0.343 0.927 1.00 0.00 H new ATOM 33 P A A 2 7.341 -6.110 7.787 1.00 0.00 P ATOM 34 OP1 A A 2 8.307 -6.477 8.845 1.00 0.00 O ATOM 35 OP2 A A 2 5.890 -6.132 8.079 1.00 0.00 O ATOM 36 O5' A A 2 7.718 -4.638 7.251 1.00 0.00 O ATOM 37 C5' A A 2 9.065 -4.240 7.089 1.00 0.00 C ATOM 38 C4' A A 2 9.103 -2.798 6.579 1.00 0.00 C ATOM 39 O4' A A 2 8.394 -2.664 5.354 1.00 0.00 O ATOM 40 C3' A A 2 8.412 -1.846 7.528 1.00 0.00 C ATOM 41 O3' A A 2 9.210 -1.545 8.662 1.00 0.00 O ATOM 42 C2' A A 2 8.213 -0.656 6.626 1.00 0.00 C ATOM 43 O2' A A 2 9.425 0.056 6.501 1.00 0.00 O ATOM 44 C1' A A 2 7.897 -1.320 5.286 1.00 0.00 C ATOM 45 N9 A A 2 6.436 -1.324 5.047 1.00 0.00 N ATOM 46 C8 A A 2 5.540 -2.356 5.176 1.00 0.00 C ATOM 47 N7 A A 2 4.313 -2.033 4.865 1.00 0.00 N ATOM 48 C5 A A 2 4.402 -0.691 4.504 1.00 0.00 C ATOM 49 C6 A A 2 3.446 0.245 4.060 1.00 0.00 C ATOM 50 N6 A A 2 2.151 -0.048 3.894 1.00 0.00 N ATOM 51 N1 A A 2 3.872 1.494 3.790 1.00 0.00 N ATOM 52 C2 A A 2 5.160 1.784 3.952 1.00 0.00 C ATOM 53 N3 A A 2 6.151 0.997 4.354 1.00 0.00 N ATOM 54 C4 A A 2 5.692 -0.250 4.617 1.00 0.00 C ATOM 0 H5' A A 2 9.570 -4.901 6.385 1.00 0.00 H new ATOM 0 H5'' A A 2 9.597 -4.318 8.037 1.00 0.00 H new ATOM 0 H4' A A 2 10.162 -2.562 6.471 1.00 0.00 H new ATOM 0 H3' A A 2 7.493 -2.231 7.970 1.00 0.00 H new ATOM 0 H2' A A 2 7.454 0.041 6.981 1.00 0.00 H new ATOM 0 HO2' A A 2 10.090 -0.319 7.116 1.00 0.00 H new ATOM 0 H1' A A 2 8.364 -0.776 4.465 1.00 0.00 H new ATOM 0 H8 A A 2 5.824 -3.345 5.505 1.00 0.00 H new ATOM 0 H61 A A 2 1.503 0.670 3.570 1.00 0.00 H new ATOM 0 H62 A A 2 1.812 -0.989 4.092 1.00 0.00 H new ATOM 0 H2 A A 2 5.439 2.802 3.725 1.00 0.00 H new ATOM 66 P G A 3 8.576 -0.822 9.961 1.00 0.00 P ATOM 67 OP1 G A 3 9.655 -0.633 10.955 1.00 0.00 O ATOM 68 OP2 G A 3 7.352 -1.561 10.340 1.00 0.00 O ATOM 69 O5' G A 3 8.134 0.627 9.422 1.00 0.00 O ATOM 70 C5' G A 3 9.086 1.647 9.190 1.00 0.00 C ATOM 71 C4' G A 3 8.360 2.862 8.614 1.00 0.00 C ATOM 72 O4' G A 3 7.677 2.509 7.416 1.00 0.00 O ATOM 73 C3' G A 3 7.292 3.382 9.538 1.00 0.00 C ATOM 74 O3' G A 3 7.835 4.156 10.599 1.00 0.00 O ATOM 75 C2' G A 3 6.509 4.226 8.557 1.00 0.00 C ATOM 76 O2' G A 3 7.183 5.441 8.325 1.00 0.00 O ATOM 77 C1' G A 3 6.567 3.395 7.281 1.00 0.00 C ATOM 78 N9 G A 3 5.305 2.644 7.146 1.00 0.00 N ATOM 79 C8 G A 3 5.008 1.357 7.517 1.00 0.00 C ATOM 80 N7 G A 3 3.768 1.016 7.295 1.00 0.00 N ATOM 81 C5 G A 3 3.201 2.163 6.743 1.00 0.00 C ATOM 82 C6 G A 3 1.867 2.408 6.299 1.00 0.00 C ATOM 83 O6 G A 3 0.908 1.640 6.296 1.00 0.00 O ATOM 84 N1 G A 3 1.720 3.705 5.821 1.00 0.00 N ATOM 85 C2 G A 3 2.724 4.647 5.767 1.00 0.00 C ATOM 86 N2 G A 3 2.402 5.845 5.272 1.00 0.00 N ATOM 87 N3 G A 3 3.972 4.419 6.176 1.00 0.00 N ATOM 88 C4 G A 3 4.137 3.162 6.652 1.00 0.00 C ATOM 0 H5' G A 3 9.853 1.300 8.497 1.00 0.00 H new ATOM 0 H5'' G A 3 9.592 1.912 10.118 1.00 0.00 H new ATOM 0 H4' G A 3 9.131 3.615 8.453 1.00 0.00 H new ATOM 0 H3' G A 3 6.713 2.619 10.058 1.00 0.00 H new ATOM 0 H2' G A 3 5.502 4.461 8.901 1.00 0.00 H new ATOM 0 HO2' G A 3 7.949 5.512 8.933 1.00 0.00 H new ATOM 0 H1' G A 3 6.689 4.014 6.392 1.00 0.00 H new ATOM 0 H8 G A 3 5.734 0.687 7.953 1.00 0.00 H new ATOM 0 H1 G A 3 0.798 3.981 5.484 1.00 0.00 H new ATOM 0 H21 G A 3 3.109 6.578 5.210 1.00 0.00 H new ATOM 0 H22 G A 3 1.449 6.027 4.956 1.00 0.00 H new ATOM 100 P G A 4 6.891 4.737 11.781 1.00 0.00 P ATOM 101 OP1 G A 4 7.769 5.217 12.871 1.00 0.00 O ATOM 102 OP2 G A 4 5.852 3.725 12.069 1.00 0.00 O ATOM 103 O5' G A 4 6.164 6.027 11.125 1.00 0.00 O ATOM 104 C5' G A 4 6.844 7.265 10.987 1.00 0.00 C ATOM 105 C4' G A 4 5.870 8.328 10.461 1.00 0.00 C ATOM 106 O4' G A 4 5.301 7.942 9.207 1.00 0.00 O ATOM 107 C3' G A 4 4.696 8.527 11.401 1.00 0.00 C ATOM 108 O3' G A 4 5.019 9.396 12.470 1.00 0.00 O ATOM 109 C2' G A 4 3.697 9.159 10.463 1.00 0.00 C ATOM 110 O2' G A 4 4.043 10.511 10.242 1.00 0.00 O ATOM 111 C1' G A 4 3.933 8.384 9.177 1.00 0.00 C ATOM 112 N9 G A 4 3.036 7.215 9.101 1.00 0.00 N ATOM 113 C8 G A 4 3.348 5.898 9.271 1.00 0.00 C ATOM 114 N7 G A 4 2.349 5.083 9.076 1.00 0.00 N ATOM 115 C5 G A 4 1.289 5.926 8.756 1.00 0.00 C ATOM 116 C6 G A 4 -0.066 5.614 8.441 1.00 0.00 C ATOM 117 O6 G A 4 -0.597 4.509 8.367 1.00 0.00 O ATOM 118 N1 G A 4 -0.815 6.761 8.205 1.00 0.00 N ATOM 119 C2 G A 4 -0.322 8.048 8.246 1.00 0.00 C ATOM 120 N2 G A 4 -1.193 9.032 7.994 1.00 0.00 N ATOM 121 N3 G A 4 0.953 8.345 8.528 1.00 0.00 N ATOM 122 C4 G A 4 1.699 7.238 8.776 1.00 0.00 C ATOM 0 H5' G A 4 7.685 7.156 10.302 1.00 0.00 H new ATOM 0 H5'' G A 4 7.254 7.576 11.948 1.00 0.00 H new ATOM 0 H4' G A 4 6.459 9.240 10.367 1.00 0.00 H new ATOM 0 H3' G A 4 4.352 7.616 11.892 1.00 0.00 H new ATOM 0 H2' G A 4 2.671 9.132 10.831 1.00 0.00 H new ATOM 0 HO2' G A 4 4.696 10.796 10.915 1.00 0.00 H new ATOM 0 H1' G A 4 3.733 9.012 8.309 1.00 0.00 H new ATOM 0 H8 G A 4 4.337 5.560 9.543 1.00 0.00 H new ATOM 0 H1 G A 4 -1.804 6.642 7.985 1.00 0.00 H new ATOM 0 H21 G A 4 -0.883 10.004 8.011 1.00 0.00 H new ATOM 0 H22 G A 4 -2.166 8.810 7.785 1.00 0.00 H new ATOM 134 P U A 5 4.160 9.383 13.832 1.00 0.00 P ATOM 135 OP1 U A 5 4.546 10.566 14.633 1.00 0.00 O ATOM 136 OP2 U A 5 4.270 8.031 14.422 1.00 0.00 O ATOM 137 O5' U A 5 2.641 9.583 13.336 1.00 0.00 O ATOM 138 C5' U A 5 2.153 10.844 12.933 1.00 0.00 C ATOM 139 C4' U A 5 0.658 10.726 12.598 1.00 0.00 C ATOM 140 O4' U A 5 0.394 9.970 11.409 1.00 0.00 O ATOM 141 C3' U A 5 -0.118 10.055 13.698 1.00 0.00 C ATOM 142 O3' U A 5 -0.351 10.918 14.795 1.00 0.00 O ATOM 143 C2' U A 5 -1.378 9.744 12.938 1.00 0.00 C ATOM 144 O2' U A 5 -2.124 10.924 12.723 1.00 0.00 O ATOM 145 C1' U A 5 -0.839 9.252 11.615 1.00 0.00 C ATOM 146 N1 U A 5 -0.550 7.800 11.671 1.00 0.00 N ATOM 147 C2 U A 5 -1.567 6.904 11.357 1.00 0.00 C ATOM 148 O2 U A 5 -2.711 7.269 11.087 1.00 0.00 O ATOM 149 N3 U A 5 -1.218 5.563 11.363 1.00 0.00 N ATOM 150 C4 U A 5 0.036 5.048 11.655 1.00 0.00 C ATOM 151 O4 U A 5 0.236 3.837 11.629 1.00 0.00 O ATOM 152 C5 U A 5 1.025 6.053 11.974 1.00 0.00 C ATOM 153 C6 U A 5 0.704 7.367 11.968 1.00 0.00 C ATOM 0 H5' U A 5 2.705 11.200 12.063 1.00 0.00 H new ATOM 0 H5'' U A 5 2.303 11.576 13.727 1.00 0.00 H new ATOM 0 H4' U A 5 0.343 11.760 12.460 1.00 0.00 H new ATOM 0 H3' U A 5 0.372 9.200 14.163 1.00 0.00 H new ATOM 0 H2' U A 5 -2.033 9.040 13.451 1.00 0.00 H new ATOM 0 HO2' U A 5 -1.818 11.621 13.340 1.00 0.00 H new ATOM 0 H1' U A 5 -1.560 9.415 10.814 1.00 0.00 H new ATOM 0 H3 U A 5 -1.951 4.893 11.131 1.00 0.00 H new ATOM 0 H5 U A 5 2.032 5.751 12.220 1.00 0.00 H new ATOM 0 H6 U A 5 1.467 8.094 12.206 1.00 0.00 H new ATOM 164 P C A 6 -0.798 10.325 16.226 1.00 0.00 P ATOM 165 OP1 C A 6 -1.097 11.461 17.126 1.00 0.00 O ATOM 166 OP2 C A 6 0.200 9.311 16.631 1.00 0.00 O ATOM 167 O5' C A 6 -2.174 9.564 15.901 1.00 0.00 O ATOM 168 C5' C A 6 -3.364 10.283 15.668 1.00 0.00 C ATOM 169 C4' C A 6 -4.482 9.301 15.317 1.00 0.00 C ATOM 170 O4' C A 6 -4.190 8.572 14.125 1.00 0.00 O ATOM 171 C3' C A 6 -4.684 8.252 16.390 1.00 0.00 C ATOM 172 O3' C A 6 -5.409 8.740 17.501 1.00 0.00 O ATOM 173 C2' C A 6 -5.468 7.230 15.609 1.00 0.00 C ATOM 174 O2' C A 6 -6.800 7.670 15.437 1.00 0.00 O ATOM 175 C1' C A 6 -4.764 7.262 14.257 1.00 0.00 C ATOM 176 N1 C A 6 -3.706 6.221 14.220 1.00 0.00 N ATOM 177 C2 C A 6 -4.122 4.912 14.023 1.00 0.00 C ATOM 178 O2 C A 6 -5.311 4.665 13.845 1.00 0.00 O ATOM 179 N3 C A 6 -3.185 3.926 14.035 1.00 0.00 N ATOM 180 C4 C A 6 -1.892 4.207 14.238 1.00 0.00 C ATOM 181 N4 C A 6 -1.009 3.205 14.252 1.00 0.00 N ATOM 182 C5 C A 6 -1.444 5.555 14.432 1.00 0.00 C ATOM 183 C6 C A 6 -2.384 6.525 14.408 1.00 0.00 C ATOM 0 H5' C A 6 -3.220 10.995 14.855 1.00 0.00 H new ATOM 0 H5'' C A 6 -3.634 10.860 16.553 1.00 0.00 H new ATOM 0 H4' C A 6 -5.370 9.922 15.203 1.00 0.00 H new ATOM 0 H3' C A 6 -3.763 7.884 16.842 1.00 0.00 H new ATOM 0 H2' C A 6 -5.507 6.250 16.084 1.00 0.00 H new ATOM 0 HO2' C A 6 -7.302 7.001 14.927 1.00 0.00 H new ATOM 0 H1' C A 6 -5.455 7.060 13.439 1.00 0.00 H new ATOM 0 H41 C A 6 -0.019 3.399 14.405 1.00 0.00 H new ATOM 0 H42 C A 6 -1.324 2.245 14.110 1.00 0.00 H new ATOM 0 H5 C A 6 -0.401 5.785 14.590 1.00 0.00 H new ATOM 0 H6 C A 6 -2.089 7.555 14.539 1.00 0.00 H new ATOM 195 P U A 7 -5.423 7.928 18.897 1.00 0.00 P ATOM 196 OP1 U A 7 -6.299 8.655 19.843 1.00 0.00 O ATOM 197 OP2 U A 7 -4.019 7.645 19.270 1.00 0.00 O ATOM 198 O5' U A 7 -6.131 6.526 18.533 1.00 0.00 O ATOM 199 C5' U A 7 -7.528 6.444 18.340 1.00 0.00 C ATOM 200 C4' U A 7 -7.926 4.986 18.097 1.00 0.00 C ATOM 201 O4' U A 7 -7.291 4.444 16.934 1.00 0.00 O ATOM 202 C3' U A 7 -7.492 4.079 19.229 1.00 0.00 C ATOM 203 O3' U A 7 -8.317 4.180 20.375 1.00 0.00 O ATOM 204 C2' U A 7 -7.641 2.747 18.550 1.00 0.00 C ATOM 205 O2' U A 7 -9.009 2.412 18.452 1.00 0.00 O ATOM 206 C1' U A 7 -7.115 3.031 17.153 1.00 0.00 C ATOM 207 N1 U A 7 -5.682 2.646 17.046 1.00 0.00 N ATOM 208 C2 U A 7 -5.402 1.293 16.909 1.00 0.00 C ATOM 209 O2 U A 7 -6.286 0.439 16.892 1.00 0.00 O ATOM 210 N3 U A 7 -4.067 0.951 16.788 1.00 0.00 N ATOM 211 C4 U A 7 -2.997 1.827 16.796 1.00 0.00 C ATOM 212 O4 U A 7 -1.847 1.407 16.693 1.00 0.00 O ATOM 213 C5 U A 7 -3.375 3.220 16.930 1.00 0.00 C ATOM 214 C6 U A 7 -4.676 3.581 17.045 1.00 0.00 C ATOM 0 H5' U A 7 -7.825 7.059 17.491 1.00 0.00 H new ATOM 0 H5'' U A 7 -8.050 6.834 19.214 1.00 0.00 H new ATOM 0 H4' U A 7 -9.011 5.014 17.994 1.00 0.00 H new ATOM 0 H3' U A 7 -6.502 4.300 19.628 1.00 0.00 H new ATOM 0 H2' U A 7 -7.133 1.936 19.071 1.00 0.00 H new ATOM 0 HO2' U A 7 -9.102 1.543 18.008 1.00 0.00 H new ATOM 0 H1' U A 7 -7.650 2.452 16.401 1.00 0.00 H new ATOM 0 H3 U A 7 -3.852 -0.040 16.683 1.00 0.00 H new ATOM 0 H5 U A 7 -2.609 3.981 16.938 1.00 0.00 H new ATOM 0 H6 U A 7 -4.927 4.627 17.138 1.00 0.00 H new ATOM 225 P C A 8 -7.891 3.466 21.763 1.00 0.00 P ATOM 226 OP1 C A 8 -8.941 3.747 22.767 1.00 0.00 O ATOM 227 OP2 C A 8 -6.487 3.832 22.050 1.00 0.00 O ATOM 228 O5' C A 8 -7.933 1.887 21.425 1.00 0.00 O ATOM 229 C5' C A 8 -9.162 1.197 21.322 1.00 0.00 C ATOM 230 C4' C A 8 -8.902 -0.283 21.013 1.00 0.00 C ATOM 231 O4' C A 8 -8.173 -0.455 19.803 1.00 0.00 O ATOM 232 C3' C A 8 -8.051 -0.955 22.067 1.00 0.00 C ATOM 233 O3' C A 8 -8.772 -1.246 23.245 1.00 0.00 O ATOM 234 C2' C A 8 -7.637 -2.203 21.339 1.00 0.00 C ATOM 235 O2' C A 8 -8.703 -3.131 21.326 1.00 0.00 O ATOM 236 C1' C A 8 -7.408 -1.670 19.923 1.00 0.00 C ATOM 237 N1 C A 8 -5.957 -1.402 19.721 1.00 0.00 N ATOM 238 C2 C A 8 -5.132 -2.491 19.465 1.00 0.00 C ATOM 239 O2 C A 8 -5.606 -3.622 19.386 1.00 0.00 O ATOM 240 N3 C A 8 -3.796 -2.268 19.308 1.00 0.00 N ATOM 241 C4 C A 8 -3.289 -1.030 19.400 1.00 0.00 C ATOM 242 N4 C A 8 -1.976 -0.853 19.229 1.00 0.00 N ATOM 243 C5 C A 8 -4.127 0.100 19.670 1.00 0.00 C ATOM 244 C6 C A 8 -5.447 -0.138 19.820 1.00 0.00 C ATOM 0 H5' C A 8 -9.774 1.640 20.536 1.00 0.00 H new ATOM 0 H5'' C A 8 -9.722 1.291 22.253 1.00 0.00 H new ATOM 0 H4' C A 8 -9.898 -0.722 20.960 1.00 0.00 H new ATOM 0 H3' C A 8 -7.224 -0.342 22.426 1.00 0.00 H new ATOM 0 H2' C A 8 -6.779 -2.712 21.778 1.00 0.00 H new ATOM 0 HO2' C A 8 -9.188 -3.085 22.177 1.00 0.00 H new ATOM 0 HO3' C A 8 -8.179 -1.680 23.893 1.00 0.00 H new ATOM 0 H1' C A 8 -7.722 -2.391 19.168 1.00 0.00 H new ATOM 0 H41 C A 8 -1.575 0.082 19.296 1.00 0.00 H new ATOM 0 H42 C A 8 -1.375 -1.653 19.032 1.00 0.00 H new ATOM 0 H5 C A 8 -3.721 1.098 19.750 1.00 0.00 H new ATOM 0 H6 C A 8 -6.114 0.687 20.022 1.00 0.00 H new TER 257 C A 8 ATOM 258 O5' G B 9 3.428 -10.964 14.875 1.00 0.00 O ATOM 259 C5' G B 9 3.232 -10.293 16.101 1.00 0.00 C ATOM 260 C4' G B 9 1.740 -10.259 16.441 1.00 0.00 C ATOM 261 O4' G B 9 1.510 -9.570 17.669 1.00 0.00 O ATOM 262 C3' G B 9 0.938 -9.500 15.402 1.00 0.00 C ATOM 263 O3' G B 9 0.665 -10.280 14.253 1.00 0.00 O ATOM 264 C2' G B 9 -0.311 -9.202 16.191 1.00 0.00 C ATOM 265 O2' G B 9 -1.110 -10.363 16.290 1.00 0.00 O ATOM 266 C1' G B 9 0.256 -8.879 17.565 1.00 0.00 C ATOM 267 N9 G B 9 0.479 -7.424 17.671 1.00 0.00 N ATOM 268 C8 G B 9 1.615 -6.706 17.411 1.00 0.00 C ATOM 269 N7 G B 9 1.490 -5.423 17.607 1.00 0.00 N ATOM 270 C5 G B 9 0.169 -5.277 18.020 1.00 0.00 C ATOM 271 C6 G B 9 -0.557 -4.101 18.372 1.00 0.00 C ATOM 272 O6 G B 9 -0.156 -2.940 18.405 1.00 0.00 O ATOM 273 N1 G B 9 -1.875 -4.393 18.704 1.00 0.00 N ATOM 274 C2 G B 9 -2.429 -5.656 18.705 1.00 0.00 C ATOM 275 N2 G B 9 -3.717 -5.748 19.046 1.00 0.00 N ATOM 276 N3 G B 9 -1.749 -6.761 18.385 1.00 0.00 N ATOM 277 C4 G B 9 -0.460 -6.498 18.052 1.00 0.00 C ATOM 0 H5' G B 9 3.623 -9.278 16.037 1.00 0.00 H new ATOM 0 H5'' G B 9 3.784 -10.797 16.894 1.00 0.00 H new ATOM 0 H4' G B 9 1.431 -11.303 16.492 1.00 0.00 H new ATOM 0 H3' G B 9 1.443 -8.624 14.995 1.00 0.00 H new ATOM 0 H2' G B 9 -0.929 -8.418 15.754 1.00 0.00 H new ATOM 0 HO2' G B 9 -1.919 -10.161 16.805 1.00 0.00 H new ATOM 0 HO5' G B 9 2.582 -10.999 14.382 1.00 0.00 H new ATOM 0 H1' G B 9 -0.426 -9.185 18.359 1.00 0.00 H new ATOM 0 H8 G B 9 2.534 -7.162 17.073 1.00 0.00 H new ATOM 0 H1 G B 9 -2.478 -3.614 18.967 1.00 0.00 H new ATOM 0 H21 G B 9 -4.176 -6.659 19.063 1.00 0.00 H new ATOM 0 H22 G B 9 -4.241 -4.908 19.289 1.00 0.00 H new ATOM 290 P A B 10 0.151 -9.586 12.889 1.00 0.00 P ATOM 291 OP1 A B 10 -0.112 -10.655 11.901 1.00 0.00 O ATOM 292 OP2 A B 10 1.094 -8.495 12.556 1.00 0.00 O ATOM 293 O5' A B 10 -1.258 -8.920 13.297 1.00 0.00 O ATOM 294 C5' A B 10 -2.420 -9.708 13.455 1.00 0.00 C ATOM 295 C4' A B 10 -3.592 -8.803 13.839 1.00 0.00 C ATOM 296 O4' A B 10 -3.327 -8.095 15.044 1.00 0.00 O ATOM 297 C3' A B 10 -3.839 -7.726 12.808 1.00 0.00 C ATOM 298 O3' A B 10 -4.498 -8.226 11.656 1.00 0.00 O ATOM 299 C2' A B 10 -4.698 -6.781 13.605 1.00 0.00 C ATOM 300 O2' A B 10 -6.012 -7.291 13.695 1.00 0.00 O ATOM 301 C1' A B 10 -4.047 -6.856 14.987 1.00 0.00 C ATOM 302 N9 A B 10 -3.121 -5.716 15.176 1.00 0.00 N ATOM 303 C8 A B 10 -1.754 -5.677 15.049 1.00 0.00 C ATOM 304 N7 A B 10 -1.234 -4.503 15.283 1.00 0.00 N ATOM 305 C5 A B 10 -2.334 -3.706 15.590 1.00 0.00 C ATOM 306 C6 A B 10 -2.462 -2.346 15.937 1.00 0.00 C ATOM 307 N6 A B 10 -1.422 -1.510 16.032 1.00 0.00 N ATOM 308 N1 A B 10 -3.700 -1.878 16.183 1.00 0.00 N ATOM 309 C2 A B 10 -4.735 -2.709 16.088 1.00 0.00 C ATOM 310 N3 A B 10 -4.745 -3.998 15.771 1.00 0.00 N ATOM 311 C4 A B 10 -3.487 -4.439 15.531 1.00 0.00 C ATOM 0 H5' A B 10 -2.260 -10.463 14.225 1.00 0.00 H new ATOM 0 H5'' A B 10 -2.643 -10.239 12.529 1.00 0.00 H new ATOM 0 H4' A B 10 -4.447 -9.473 13.932 1.00 0.00 H new ATOM 0 H3' A B 10 -2.937 -7.274 12.395 1.00 0.00 H new ATOM 0 H2' A B 10 -4.762 -5.778 13.182 1.00 0.00 H new ATOM 0 HO2' A B 10 -6.568 -6.674 14.215 1.00 0.00 H new ATOM 0 H1' A B 10 -4.798 -6.808 15.775 1.00 0.00 H new ATOM 0 H8 A B 10 -1.163 -6.540 14.780 1.00 0.00 H new ATOM 0 H61 A B 10 -1.574 -0.534 16.287 1.00 0.00 H new ATOM 0 H62 A B 10 -0.477 -1.848 15.849 1.00 0.00 H new ATOM 0 H2 A B 10 -5.701 -2.274 16.298 1.00 0.00 H new ATOM 323 P G B 11 -4.561 -7.361 10.291 1.00 0.00 P ATOM 324 OP1 G B 11 -5.324 -8.139 9.289 1.00 0.00 O ATOM 325 OP2 G B 11 -3.189 -6.907 9.977 1.00 0.00 O ATOM 326 O5' G B 11 -5.433 -6.070 10.690 1.00 0.00 O ATOM 327 C5' G B 11 -6.836 -6.150 10.838 1.00 0.00 C ATOM 328 C4' G B 11 -7.356 -4.782 11.279 1.00 0.00 C ATOM 329 O4' G B 11 -6.737 -4.380 12.494 1.00 0.00 O ATOM 330 C3' G B 11 -7.028 -3.694 10.291 1.00 0.00 C ATOM 331 O3' G B 11 -7.898 -3.708 9.171 1.00 0.00 O ATOM 332 C2' G B 11 -7.254 -2.484 11.168 1.00 0.00 C ATOM 333 O2' G B 11 -8.636 -2.211 11.269 1.00 0.00 O ATOM 334 C1' G B 11 -6.752 -2.954 12.530 1.00 0.00 C ATOM 335 N9 G B 11 -5.398 -2.415 12.748 1.00 0.00 N ATOM 336 C8 G B 11 -4.178 -3.021 12.590 1.00 0.00 C ATOM 337 N7 G B 11 -3.163 -2.231 12.813 1.00 0.00 N ATOM 338 C5 G B 11 -3.754 -1.012 13.137 1.00 0.00 C ATOM 339 C6 G B 11 -3.159 0.241 13.471 1.00 0.00 C ATOM 340 O6 G B 11 -1.965 0.521 13.560 1.00 0.00 O ATOM 341 N1 G B 11 -4.122 1.216 13.711 1.00 0.00 N ATOM 342 C2 G B 11 -5.485 1.013 13.649 1.00 0.00 C ATOM 343 N2 G B 11 -6.267 2.060 13.920 1.00 0.00 N ATOM 344 N3 G B 11 -6.042 -0.159 13.343 1.00 0.00 N ATOM 345 C4 G B 11 -5.121 -1.121 13.098 1.00 0.00 C ATOM 0 H5' G B 11 -7.096 -6.910 11.575 1.00 0.00 H new ATOM 0 H5'' G B 11 -7.300 -6.446 9.897 1.00 0.00 H new ATOM 0 H4' G B 11 -8.435 -4.902 11.377 1.00 0.00 H new ATOM 0 H3' G B 11 -6.038 -3.763 9.840 1.00 0.00 H new ATOM 0 H2' G B 11 -6.764 -1.586 10.791 1.00 0.00 H new ATOM 0 HO2' G B 11 -8.774 -1.426 11.840 1.00 0.00 H new ATOM 0 H1' G B 11 -7.388 -2.609 13.345 1.00 0.00 H new ATOM 0 H8 G B 11 -4.067 -4.057 12.307 1.00 0.00 H new ATOM 0 H1 G B 11 -3.795 2.152 13.951 1.00 0.00 H new ATOM 0 H21 G B 11 -7.282 1.961 13.887 1.00 0.00 H new ATOM 0 H22 G B 11 -5.850 2.959 14.160 1.00 0.00 H new ATOM 357 P G B 12 -7.708 -2.660 7.950 1.00 0.00 P ATOM 358 OP1 G B 12 -8.587 -3.089 6.840 1.00 0.00 O ATOM 359 OP2 G B 12 -6.256 -2.500 7.713 1.00 0.00 O ATOM 360 O5' G B 12 -8.279 -1.258 8.523 1.00 0.00 O ATOM 361 C5' G B 12 -9.672 -1.046 8.685 1.00 0.00 C ATOM 362 C4' G B 12 -9.930 0.404 9.121 1.00 0.00 C ATOM 363 O4' G B 12 -9.273 0.707 10.355 1.00 0.00 O ATOM 364 C3' G B 12 -9.397 1.405 8.113 1.00 0.00 C ATOM 365 O3' G B 12 -10.295 1.613 7.038 1.00 0.00 O ATOM 366 C2' G B 12 -9.302 2.635 8.977 1.00 0.00 C ATOM 367 O2' G B 12 -10.597 3.160 9.188 1.00 0.00 O ATOM 368 C1' G B 12 -8.798 2.063 10.291 1.00 0.00 C ATOM 369 N9 G B 12 -7.324 2.069 10.335 1.00 0.00 N ATOM 370 C8 G B 12 -6.470 1.007 10.252 1.00 0.00 C ATOM 371 N7 G B 12 -5.211 1.323 10.386 1.00 0.00 N ATOM 372 C5 G B 12 -5.232 2.702 10.570 1.00 0.00 C ATOM 373 C6 G B 12 -4.155 3.616 10.771 1.00 0.00 C ATOM 374 O6 G B 12 -2.953 3.375 10.836 1.00 0.00 O ATOM 375 N1 G B 12 -4.609 4.924 10.893 1.00 0.00 N ATOM 376 C2 G B 12 -5.932 5.308 10.851 1.00 0.00 C ATOM 377 N2 G B 12 -6.181 6.615 10.987 1.00 0.00 N ATOM 378 N3 G B 12 -6.947 4.453 10.675 1.00 0.00 N ATOM 379 C4 G B 12 -6.524 3.170 10.537 1.00 0.00 C ATOM 0 H5' G B 12 -10.070 -1.736 9.429 1.00 0.00 H new ATOM 0 H5'' G B 12 -10.192 -1.252 7.749 1.00 0.00 H new ATOM 0 H4' G B 12 -11.013 0.484 9.216 1.00 0.00 H new ATOM 0 H3' G B 12 -8.468 1.099 7.631 1.00 0.00 H new ATOM 0 H2' G B 12 -8.680 3.424 8.554 1.00 0.00 H new ATOM 0 HO2' G B 12 -11.170 2.934 8.426 1.00 0.00 H new ATOM 0 H1' G B 12 -9.156 2.660 11.130 1.00 0.00 H new ATOM 0 H8 G B 12 -6.807 -0.006 10.090 1.00 0.00 H new ATOM 0 H1 G B 12 -3.910 5.655 11.024 1.00 0.00 H new ATOM 0 H21 G B 12 -7.142 6.956 10.964 1.00 0.00 H new ATOM 0 H22 G B 12 -5.410 7.271 11.114 1.00 0.00 H new ATOM 391 P U B 13 -9.777 2.207 5.631 1.00 0.00 P ATOM 392 OP1 U B 13 -10.960 2.601 4.835 1.00 0.00 O ATOM 393 OP2 U B 13 -8.801 1.248 5.069 1.00 0.00 O ATOM 394 O5' U B 13 -8.976 3.545 6.040 1.00 0.00 O ATOM 395 C5' U B 13 -9.647 4.744 6.368 1.00 0.00 C ATOM 396 C4' U B 13 -8.615 5.852 6.627 1.00 0.00 C ATOM 397 O4' U B 13 -7.838 5.646 7.813 1.00 0.00 O ATOM 398 C3' U B 13 -7.631 5.989 5.501 1.00 0.00 C ATOM 399 O3' U B 13 -8.185 6.664 4.387 1.00 0.00 O ATOM 400 C2' U B 13 -6.590 6.813 6.206 1.00 0.00 C ATOM 401 O2' U B 13 -7.044 8.140 6.371 1.00 0.00 O ATOM 402 C1' U B 13 -6.514 6.152 7.557 1.00 0.00 C ATOM 403 N1 U B 13 -5.558 5.025 7.536 1.00 0.00 N ATOM 404 C2 U B 13 -4.216 5.287 7.783 1.00 0.00 C ATOM 405 O2 U B 13 -3.788 6.425 7.973 1.00 0.00 O ATOM 406 N3 U B 13 -3.376 4.184 7.808 1.00 0.00 N ATOM 407 C4 U B 13 -3.756 2.866 7.604 1.00 0.00 C ATOM 408 O4 U B 13 -2.925 1.963 7.646 1.00 0.00 O ATOM 409 C5 U B 13 -5.169 2.693 7.352 1.00 0.00 C ATOM 410 C6 U B 13 -6.004 3.757 7.330 1.00 0.00 C ATOM 0 H5' U B 13 -10.268 4.596 7.252 1.00 0.00 H new ATOM 0 H5'' U B 13 -10.313 5.035 5.556 1.00 0.00 H new ATOM 0 H4' U B 13 -9.225 6.749 6.732 1.00 0.00 H new ATOM 0 H3' U B 13 -7.276 5.054 5.068 1.00 0.00 H new ATOM 0 H2' U B 13 -5.642 6.860 5.670 1.00 0.00 H new ATOM 0 HO2' U B 13 -6.358 8.666 6.832 1.00 0.00 H new ATOM 0 H1' U B 13 -6.178 6.854 8.320 1.00 0.00 H new ATOM 0 H3 U B 13 -2.388 4.358 7.993 1.00 0.00 H new ATOM 0 H5 U B 13 -5.563 1.702 7.179 1.00 0.00 H new ATOM 0 H6 U B 13 -7.055 3.595 7.143 1.00 0.00 H new ATOM 421 P C B 14 -7.449 6.630 2.954 1.00 0.00 P ATOM 422 OP1 C B 14 -8.191 7.518 2.031 1.00 0.00 O ATOM 423 OP2 C B 14 -7.225 5.214 2.590 1.00 0.00 O ATOM 424 O5' C B 14 -6.018 7.298 3.252 1.00 0.00 O ATOM 425 C5' C B 14 -5.890 8.687 3.457 1.00 0.00 C ATOM 426 C4' C B 14 -4.426 9.012 3.750 1.00 0.00 C ATOM 427 O4' C B 14 -3.954 8.348 4.918 1.00 0.00 O ATOM 428 C3' C B 14 -3.519 8.567 2.625 1.00 0.00 C ATOM 429 O3' C B 14 -3.549 9.488 1.553 1.00 0.00 O ATOM 430 C2' C B 14 -2.188 8.552 3.329 1.00 0.00 C ATOM 431 O2' C B 14 -1.698 9.871 3.447 1.00 0.00 O ATOM 432 C1' C B 14 -2.567 8.040 4.721 1.00 0.00 C ATOM 433 N1 C B 14 -2.356 6.575 4.814 1.00 0.00 N ATOM 434 C2 C B 14 -1.056 6.137 5.021 1.00 0.00 C ATOM 435 O2 C B 14 -0.140 6.950 5.117 1.00 0.00 O ATOM 436 N3 C B 14 -0.832 4.798 5.115 1.00 0.00 N ATOM 437 C4 C B 14 -1.838 3.922 5.001 1.00 0.00 C ATOM 438 N4 C B 14 -1.570 2.616 5.098 1.00 0.00 N ATOM 439 C5 C B 14 -3.187 4.358 4.795 1.00 0.00 C ATOM 440 C6 C B 14 -3.397 5.689 4.718 1.00 0.00 C ATOM 0 H5' C B 14 -6.520 9.005 4.288 1.00 0.00 H new ATOM 0 H5'' C B 14 -6.227 9.231 2.575 1.00 0.00 H new ATOM 0 H4' C B 14 -4.396 10.094 3.878 1.00 0.00 H new ATOM 0 H3' C B 14 -3.786 7.616 2.164 1.00 0.00 H new ATOM 0 H2' C B 14 -1.427 7.961 2.819 1.00 0.00 H new ATOM 0 HO2' C B 14 -2.041 10.415 2.707 1.00 0.00 H new ATOM 0 H1' C B 14 -1.947 8.511 5.483 1.00 0.00 H new ATOM 0 H41 C B 14 -2.323 1.933 5.014 1.00 0.00 H new ATOM 0 H42 C B 14 -0.612 2.302 5.256 1.00 0.00 H new ATOM 0 H5 C B 14 -4.000 3.653 4.705 1.00 0.00 H new ATOM 0 H6 C B 14 -4.401 6.062 4.579 1.00 0.00 H new ATOM 452 P U B 15 -2.815 9.163 0.165 1.00 0.00 P ATOM 453 OP1 U B 15 -3.059 10.288 -0.764 1.00 0.00 O ATOM 454 OP2 U B 15 -3.183 7.786 -0.233 1.00 0.00 O ATOM 455 O5' U B 15 -1.257 9.171 0.561 1.00 0.00 O ATOM 456 C5' U B 15 -0.347 8.387 -0.168 1.00 0.00 C ATOM 457 C4' U B 15 1.074 8.553 0.370 1.00 0.00 C ATOM 458 O4' U B 15 1.193 8.112 1.731 1.00 0.00 O ATOM 459 C3' U B 15 2.003 7.693 -0.463 1.00 0.00 C ATOM 460 O3' U B 15 2.535 8.427 -1.550 1.00 0.00 O ATOM 461 C2' U B 15 3.060 7.293 0.529 1.00 0.00 C ATOM 462 O2' U B 15 3.994 8.341 0.679 1.00 0.00 O ATOM 463 C1' U B 15 2.260 7.158 1.819 1.00 0.00 C ATOM 464 N1 U B 15 1.699 5.792 2.008 1.00 0.00 N ATOM 465 C2 U B 15 2.592 4.775 2.322 1.00 0.00 C ATOM 466 O2 U B 15 3.804 4.965 2.385 1.00 0.00 O ATOM 467 N3 U B 15 2.041 3.529 2.574 1.00 0.00 N ATOM 468 C4 U B 15 0.692 3.217 2.563 1.00 0.00 C ATOM 469 O4 U B 15 0.316 2.068 2.782 1.00 0.00 O ATOM 470 C5 U B 15 -0.175 4.348 2.296 1.00 0.00 C ATOM 471 C6 U B 15 0.340 5.573 2.038 1.00 0.00 C ATOM 0 H5' U B 15 -0.377 8.672 -1.220 1.00 0.00 H new ATOM 0 H5'' U B 15 -0.640 7.339 -0.114 1.00 0.00 H new ATOM 0 H4' U B 15 1.326 9.612 0.320 1.00 0.00 H new ATOM 0 H3' U B 15 1.515 6.835 -0.925 1.00 0.00 H new ATOM 0 H2' U B 15 3.612 6.397 0.244 1.00 0.00 H new ATOM 0 HO2' U B 15 4.032 8.866 -0.148 1.00 0.00 H new ATOM 0 H1' U B 15 2.912 7.337 2.674 1.00 0.00 H new ATOM 0 H3 U B 15 2.689 2.771 2.787 1.00 0.00 H new ATOM 0 H5 U B 15 -1.246 4.211 2.303 1.00 0.00 H new ATOM 0 H6 U B 15 -0.331 6.398 1.851 1.00 0.00 H new ATOM 482 P C B 16 3.365 7.694 -2.714 1.00 0.00 P ATOM 483 OP1 C B 16 3.816 8.719 -3.681 1.00 0.00 O ATOM 484 OP2 C B 16 2.565 6.541 -3.184 1.00 0.00 O ATOM 485 O5' C B 16 4.656 7.128 -1.945 1.00 0.00 O ATOM 486 C5' C B 16 5.279 5.951 -2.393 1.00 0.00 C ATOM 487 C4' C B 16 6.422 5.557 -1.459 1.00 0.00 C ATOM 488 O4' C B 16 5.969 5.387 -0.109 1.00 0.00 O ATOM 489 C3' C B 16 6.964 4.213 -1.890 1.00 0.00 C ATOM 490 O3' C B 16 7.984 4.321 -2.861 1.00 0.00 O ATOM 491 C2' C B 16 7.469 3.640 -0.606 1.00 0.00 C ATOM 492 O2' C B 16 8.722 4.197 -0.268 1.00 0.00 O ATOM 493 C1' C B 16 6.413 4.108 0.369 1.00 0.00 C ATOM 494 N1 C B 16 5.286 3.139 0.370 1.00 0.00 N ATOM 495 C2 C B 16 5.526 1.854 0.846 1.00 0.00 C ATOM 496 O2 C B 16 6.636 1.548 1.277 1.00 0.00 O ATOM 497 N3 C B 16 4.502 0.955 0.820 1.00 0.00 N ATOM 498 C4 C B 16 3.293 1.301 0.357 1.00 0.00 C ATOM 499 N4 C B 16 2.314 0.390 0.364 1.00 0.00 N ATOM 500 C5 C B 16 3.031 2.624 -0.122 1.00 0.00 C ATOM 501 C6 C B 16 4.058 3.498 -0.091 1.00 0.00 C ATOM 0 H5' C B 16 5.662 6.098 -3.403 1.00 0.00 H new ATOM 0 H5'' C B 16 4.549 5.143 -2.443 1.00 0.00 H new ATOM 0 H4' C B 16 7.168 6.350 -1.507 1.00 0.00 H new ATOM 0 H3' C B 16 6.214 3.591 -2.379 1.00 0.00 H new ATOM 0 H2' C B 16 7.617 2.560 -0.631 1.00 0.00 H new ATOM 0 HO2' C B 16 9.119 4.615 -1.061 1.00 0.00 H new ATOM 0 HO3' C B 16 8.301 3.426 -3.104 1.00 0.00 H new ATOM 0 H1' C B 16 6.797 4.182 1.386 1.00 0.00 H new ATOM 0 H41 C B 16 1.387 0.635 0.016 1.00 0.00 H new ATOM 0 H42 C B 16 2.494 -0.550 0.718 1.00 0.00 H new ATOM 0 H5 C B 16 2.057 2.909 -0.491 1.00 0.00 H new ATOM 0 H6 C B 16 3.901 4.508 -0.441 1.00 0.00 H new TER 514 C B 16